| SpectraBase Compound ID | HuYAaKA8xh8 |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-5-21-16(19)12-8-9-13-17(20)22-15-11-7-6-10-14(15)18(2,3)4/h6-7,10-11H,5,8-9,12-13H2,1-4H3 |
| InChIKey | RFBCBIAVLBJBBC-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cjn5EodCdNe |
|---|---|
| Name | Adipic acid, ethyl 2-tert-butylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-5-21-16(19)12-8-9-13-17(20)22-15-11-7-6-10-14(15)18(2,3)4/h6-7,10-11H,5,8-9,12-13H2,1-4H3 |
| InChIKey | RFBCBIAVLBJBBC-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | C(=O)(CCCCC(OCC)=O)OC1=CC=CC=C1C(C)(C)C |